Finding intermodel H-bonds Finding intramodel H-bonds Constraints relaxed by 0.4 angstroms and 20 degrees Models used: #0 2h96_A.cif H-bonds (donor, acceptor, hydrogen, D..A dist, D-H..A dist): TYR 5.A OH TYR 20.A O no hydrogen 2.437 N/A SER 6.A OG PHE 14.A O no hydrogen 2.867 N/A SER 6.A OG THR 15.A OG1 no hydrogen 2.977 N/A GLU 8.A N GLU 8.A OE1 no hydrogen 2.691 N/A SER 12.A N ILE 9.A O no hydrogen 2.925 N/A SER 12.A OG THR 13.A O no hydrogen 3.210 N/A PHE 14.A N VAL 7.A O no hydrogen 3.122 N/A THR 15.A OG1 SER 6.A OG no hydrogen 2.977 N/A THR 15.A OG1 PHE 14.A O no hydrogen 2.718 N/A VAL 16.A N TYR 5.A O no hydrogen 2.935 N/A ARG 19.A NE ASP 39.A OD1 no hydrogen 3.334 N/A ARG 19.A NH2 ASP 39.A OD1 no hydrogen 3.493 N/A TYR 20.A N LEU 17.A O no hydrogen 2.945 N/A GLN 21.A N TYR 38.A O no hydrogen 3.496 N/A LYS 24.A N ALA 36.A O no hydrogen 3.168 N/A ILE 26.A N VAL 34.A O no hydrogen 3.300 N/A GLY 27.A N VAL 34.A O no hydrogen 2.634 N/A VAL 34.A N GLY 27.A O no hydrogen 2.559 N/A CYS 35.A N ILE 48.A O no hydrogen 2.980 N/A ALA 36.A N LYS 24.A O no hydrogen 2.767 N/A ALA 37.A N VAL 46.A O no hydrogen 2.674 N/A TYR 38.A N GLN 21.A O no hydrogen 2.941 N/A ALA 40.A N ARG 19.A O no hydrogen 2.762 N/A LEU 42.A N ASP 39.A OD1 no hydrogen 2.666 N/A GLU 43.A N ASP 39.A O no hydrogen 3.098 N/A GLU 43.A N ALA 40.A O no hydrogen 2.717 N/A VAL 46.A N ALA 37.A O no hydrogen 2.595 N/A ALA 47.A N MET 102.A O no hydrogen 2.955 N/A ILE 48.A N CYS 35.A O no hydrogen 2.838 N/A LYS 49.A N ILE 100.A O no hydrogen 2.820 N/A LYS 49.A NZ GLN 31.A OE1 no hydrogen 3.057 N/A LYS 49.A NZ GLU 67.A OE1 no hydrogen 2.823 N/A LYS 49.A NZ ASP 163.A OD2 no hydrogen 3.158 N/A LYS 50.A N ILE 33.A O no hydrogen 3.022 N/A LEU 51.A N VAL 98.A O no hydrogen 2.987 N/A SER 52.A N GLN 31.A O no hydrogen 3.073 N/A HIS 60.A ND1 ARG 53.A O no hydrogen 2.868 N/A ALA 61.A N ASN 57.A O no hydrogen 3.329 N/A LYS 62.A N GLN 58.A O no hydrogen 3.393 N/A ARG 63.A N THR 59.A O no hydrogen 2.868 N/A ARG 63.A N HIS 60.A O no hydrogen 2.746 N/A ARG 63.A NH1 GLU 177.A OE2 no hydrogen 3.458 N/A ALA 64.A N HIS 60.A O no hydrogen 2.544 N/A TYR 65.A N ALA 61.A O no hydrogen 2.889 N/A ARG 66.A N LYS 62.A O no hydrogen 3.500 N/A GLU 67.A N ARG 63.A O no hydrogen 2.669 N/A LEU 68.A N ALA 64.A O no hydrogen 2.848 N/A VAL 69.A N TYR 65.A O no hydrogen 2.782 N/A LEU 70.A N ARG 66.A O no hydrogen 2.736 N/A MET 71.A N GLU 67.A O no hydrogen 2.820 N/A LYS 72.A N LEU 68.A O no hydrogen 2.979 N/A CYS 73.A N VAL 69.A O no hydrogen 2.763 N/A CYS 73.A SG VAL 69.A O no hydrogen 3.561 N/A LYS 77.A NZ GLU 323.A OE2 no hydrogen 3.483 N/A ASN 78.A ND2 GLN 128.A OE1 no hydrogen 3.301 N/A ASN 78.A ND2 LEU 159.A O no hydrogen 3.103 N/A ILE 79.A N HIS 76.A O no hydrogen 3.300 N/A ILE 80.A N ILE 161.A O no hydrogen 3.181 N/A ASN 84.A N VAL 101.A O no hydrogen 2.808 N/A PHE 86.A N TYR 99.A O no hydrogen 2.854 N/A THR 87.A OG1 ASP 97.A O no hydrogen 3.052 N/A LYS 90.A N GLU 94.A OE1 no hydrogen 3.235 N/A PHE 95.A N SER 91.A O no hydrogen 2.861 N/A GLN 96.A N GLN 89.A OE1 no hydrogen 2.852 N/A GLN 96.A NE2 ASP 97.A OD1 no hydrogen 2.968 N/A ASP 97.A N GLN 89.A OE1 no hydrogen 2.819 N/A TYR 99.A N PHE 86.A O no hydrogen 3.003 N/A ILE 100.A N LYS 49.A O no hydrogen 2.806 N/A VAL 101.A N ASN 84.A O no hydrogen 2.827 N/A MET 102.A N ALA 47.A O no hydrogen 2.983 N/A GLU 103.A N GLY 81.A O no hydrogen 3.203 N/A ASP 106.A N VAL 153.A O no hydrogen 2.883 N/A ALA 107.A N VAL 153.A O no hydrogen 2.793 N/A ASN 108.A ND2 SER 149.A O no hydrogen 3.556 N/A ASN 108.A ND2 ILE 151.A O no hydrogen 3.066 N/A LEU 109.A N ILE 151.A O no hydrogen 2.949 N/A CYS 110.A SG ASN 108.A OD1 no hydrogen 3.685 N/A GLN 111.A N ASN 108.A O no hydrogen 2.754 N/A ILE 113.A N LEU 109.A O no hydrogen 2.772 N/A MET 115.A N VAL 112.A O no hydrogen 2.667 N/A HIS 119.A ND1 TYR 314.A OH no hydrogen 3.000 N/A MET 122.A N ASP 118.A O no hydrogen 2.917 N/A SER 123.A N HIS 119.A O no hydrogen 3.022 N/A SER 123.A OG TYR 314.A O no hydrogen 2.497 N/A TYR 124.A N GLU 120.A O no hydrogen 3.044 N/A LEU 125.A N ARG 121.A O no hydrogen 2.718 N/A LEU 126.A N MET 122.A O no hydrogen 2.972 N/A TYR 127.A N SER 123.A O no hydrogen 2.985 N/A TYR 127.A OH GLU 323.A OE1 no hydrogen 3.400 N/A GLN 128.A N TYR 124.A O no hydrogen 2.937 N/A GLN 128.A NE2 CYS 157.A O no hydrogen 2.819 N/A MET 129.A N LEU 125.A O no hydrogen 3.017 N/A LEU 130.A N LEU 126.A O no hydrogen 2.706 N/A CYS 131.A N TYR 127.A O no hydrogen 2.841 N/A CYS 131.A SG TYR 127.A O no hydrogen 3.318 N/A GLY 132.A N GLN 128.A O no hydrogen 2.900 N/A ILE 133.A N MET 129.A O no hydrogen 3.246 N/A LYS 134.A N LEU 130.A O no hydrogen 3.046 N/A LYS 134.A NZ ALA 324.A O no hydrogen 2.782 N/A HIS 135.A N CYS 131.A O no hydrogen 3.113 N/A LEU 136.A N GLY 132.A O no hydrogen 3.481 N/A HIS 137.A N ILE 133.A O no hydrogen 2.721 N/A HIS 137.A NE2 ASP 201.A OD2 no hydrogen 2.843 N/A SER 138.A N LYS 134.A O no hydrogen 2.834 N/A SER 138.A OG LYS 134.A O no hydrogen 3.303 N/A SER 138.A OG HIS 135.A O no hydrogen 2.285 N/A ALA 139.A N LEU 136.A O no hydrogen 2.985 N/A GLY 140.A N HIS 137.A O no hydrogen 2.729 N/A ILE 141.A N LEU 136.A O no hydrogen 3.085 N/A ILE 142.A N ARG 168.A O no hydrogen 2.806 N/A HIS 143.A N ASP 201.A OD2 no hydrogen 3.150 N/A ARG 144.A N ASP 201.A OD1 no hydrogen 3.145 N/A ARG 144.A NE LEU 166.A O no hydrogen 2.797 N/A ARG 144.A NH2 LEU 166.A O no hydrogen 2.546 N/A LYS 147.A NZ ASP 145.A OD1 no hydrogen 3.309 N/A LYS 147.A NZ ASP 145.A OD2 no hydrogen 3.059 N/A LYS 147.A NZ THR 182.A OG1 no hydrogen 2.776 N/A ASN 150.A N LYS 147.A O no hydrogen 3.167 N/A ASN 150.A ND2 ASP 145.A O no hydrogen 2.898 N/A ILE 151.A N PRO 148.A O no hydrogen 2.886 N/A VAL 152.A N LYS 160.A O no hydrogen 3.174 N/A VAL 153.A N ALA 107.A O no hydrogen 3.156 N/A LYS 154.A N THR 158.A O no hydrogen 3.125 N/A SER 155.A N ASP 106.A OD2 no hydrogen 2.525 N/A CYS 157.A N LYS 154.A O no hydrogen 2.887 N/A THR 158.A OG1 ASP 156.A OD1 no hydrogen 2.467 N/A LEU 159.A N GLN 128.A OE1 no hydrogen 2.929 N/A LYS 160.A N VAL 152.A O no hydrogen 2.878 N/A LYS 160.A NZ LYS 77.A O no hydrogen 2.676 N/A LYS 160.A NZ ILE 79.A O no hydrogen 3.458 N/A ILE 161.A N ASN 78.A O no hydrogen 3.043 N/A PHE 164.A N GLU 67.A OE2 no hydrogen 3.264 N/A GLY 165.A N ASP 163.A OD1 no hydrogen 3.114 N/A ALA 167.A N PHE 164.A O no hydrogen 2.587 N/A ARG 168.A N ILE 142.A O no hydrogen 3.014 N/A ARG 168.A NE TYR 196.A OH no hydrogen 2.799 N/A ARG 168.A NH1 ASP 337.A O no hydrogen 2.655 N/A THR 169.A OG1 GLY 140.A O no hydrogen 2.788 N/A SER 173.A N THR 172.A OG1 no hydrogen 2.494 N/A VAL 180.A N GLU 177.A O no hydrogen 3.509 N/A ARG 183.A NE GLY 221.A O no hydrogen 2.600 N/A TYR 185.A N THR 182.A O no hydrogen 2.806 N/A TYR 185.A OH GLU 211.A OE1 no hydrogen 2.598 N/A TYR 185.A OH GLU 211.A OE2 no hydrogen 3.153 N/A ARG 186.A N ARG 183.A O no hydrogen 2.893 N/A ARG 186.A NH1 PRO 178.A O no hydrogen 3.106 N/A GLU 189.A N GLU 189.A OE1 no hydrogen 2.698 N/A VAL 190.A N ALA 187.A O no hydrogen 2.564 N/A ILE 191.A N ALA 187.A O no hydrogen 3.116 N/A LEU 192.A N PRO 188.A O no hydrogen 2.970 N/A GLY 193.A N VAL 190.A O no hydrogen 3.031 N/A ASP 201.A N GLU 198.A O no hydrogen 3.197 N/A LEU 202.A N ASN 199.A O no hydrogen 3.170 N/A SER 204.A OG ASP 201.A O no hydrogen 3.244 N/A VAL 205.A N ASP 201.A O no hydrogen 2.948 N/A GLY 206.A N LEU 202.A O no hydrogen 3.043 N/A GLY 206.A N TRP 203.A O no hydrogen 2.721 N/A CYS 207.A N TRP 203.A O no hydrogen 2.880 N/A CYS 207.A SG TYR 184.A O no hydrogen 3.815 N/A CYS 207.A SG TRP 203.A O no hydrogen 3.874 N/A ILE 208.A N SER 204.A O no hydrogen 2.915 N/A MET 209.A N VAL 205.A O no hydrogen 3.015 N/A GLY 210.A N GLY 206.A O no hydrogen 2.795 N/A GLU 211.A N CYS 207.A O no hydrogen 3.278 N/A MET 212.A N ILE 208.A O no hydrogen 2.914 N/A CYS 214.A N GLY 210.A O no hydrogen 2.919 N/A HIS 215.A N GLU 211.A O no hydrogen 2.726 N/A HIS 215.A ND1 ILE 113.A O no hydrogen 3.118 N/A ARG 222.A N ASP 226.A OD2 no hydrogen 3.024 N/A TYR 224.A OH ILE 191.A O no hydrogen 2.651 N/A ASP 226.A N ASP 223.A OD1 no hydrogen 2.611 N/A GLN 227.A N ASP 223.A O no hydrogen 3.064 N/A GLN 227.A NE2 PRO 220.A O no hydrogen 2.505 N/A LYS 230.A N ASP 226.A O no hydrogen 3.130 N/A LYS 230.A N GLN 227.A O no hydrogen 2.789 N/A LYS 230.A NZ ASP 226.A OD2 no hydrogen 2.686 N/A VAL 231.A N GLN 227.A O no hydrogen 3.135 N/A ILE 232.A N TRP 228.A O no hydrogen 3.061 N/A GLU 233.A N ASN 229.A O no hydrogen 3.140 N/A GLN 234.A N VAL 231.A O no hydrogen 3.070 N/A LEU 235.A N VAL 231.A O no hydrogen 2.951 N/A GLY 236.A N ILE 232.A O no hydrogen 2.463 N/A THR 237.A N TYR 260.A O no hydrogen 2.661 N/A THR 237.A OG1 TYR 260.A O no hydrogen 3.452 N/A MET 243.A N CYS 239.A O no hydrogen 3.281 N/A LYS 244.A N PRO 240.A O no hydrogen 3.146 N/A LYS 245.A N PHE 242.A O no hydrogen 2.618 N/A LYS 245.A NZ ASP 299.A OD1 no hydrogen 2.751 N/A LEU 246.A N MET 243.A O no hydrogen 3.011 N/A GLN 247.A NE2 GLY 193.A O no hydrogen 3.293 N/A ARG 251.A N GLN 247.A O no hydrogen 2.876 N/A THR 252.A N PRO 248.A O no hydrogen 3.435 N/A THR 252.A OG1 PRO 248.A O no hydrogen 2.774 N/A VAL 254.A N VAL 250.A O no hydrogen 2.852 N/A GLU 255.A N ARG 251.A O no hydrogen 2.972 N/A GLU 255.A N THR 252.A O no hydrogen 3.090 N/A ASN 256.A N THR 252.A O no hydrogen 3.096 N/A ASN 256.A N TYR 253.A O no hydrogen 2.824 N/A ARG 257.A NH2 ASN 229.A OD1 no hydrogen 2.595 N/A LYS 259.A NZ GLU 255.A O no hydrogen 3.039 N/A TYR 260.A N THR 237.A OG1 no hydrogen 2.958 N/A TYR 263.A N GLN 234.A O no hydrogen 2.890 N/A LYS 267.A N SER 264.A O no hydrogen 2.743 N/A LEU 268.A N SER 264.A O no hydrogen 2.741 N/A PHE 269.A N PHE 265.A O no hydrogen 2.836 N/A LEU 273.A N PRO 270.A O no hydrogen 3.278 N/A PHE 274.A N ASP 271.A O no hydrogen 2.595 N/A HIS 280.A N SER 278.A OG no hydrogen 3.050 N/A ALA 285.A N ASP 277.A OD1 no hydrogen 2.376 N/A ALA 285.A N ASP 277.A OD2 no hydrogen 3.371 N/A GLN 287.A NE2 ASN 281.A O no hydrogen 3.518 N/A ALA 288.A N LYS 284.A O no hydrogen 3.056 N/A ARG 289.A N ALA 285.A O no hydrogen 2.746 N/A ARG 289.A NE PHE 269.A O no hydrogen 2.953 N/A ARG 289.A NH1 GLU 266.A OE2 no hydrogen 3.516 N/A ARG 289.A NH1 ASP 271.A OD1 no hydrogen 3.487 N/A ARG 289.A NH2 PHE 269.A O no hydrogen 2.761 N/A ARG 289.A NH2 ASP 271.A OD1 no hydrogen 3.138 N/A ASP 290.A N SER 286.A O no hydrogen 2.827 N/A LEU 291.A N GLN 287.A O no hydrogen 2.807 N/A LEU 292.A N ALA 288.A O no hydrogen 3.081 N/A SER 293.A N ARG 289.A O no hydrogen 2.973 N/A SER 293.A OG ASP 290.A O no hydrogen 2.843 N/A LYS 294.A N LEU 291.A O no hydrogen 3.006 N/A MET 295.A N LEU 292.A O no hydrogen 2.866 N/A LEU 296.A N LEU 292.A O no hydrogen 2.899 N/A VAL 297.A N MET 295.A O no hydrogen 2.802 N/A SER 301.A OG ASP 299.A OD1 no hydrogen 2.520 N/A LYS 302.A N ASP 299.A O no hydrogen 2.805 N/A LYS 302.A NZ GLU 241.A OE2 no hydrogen 3.554 N/A ARG 303.A N ALA 300.A O no hydrogen 2.806 N/A ARG 303.A NE VAL 297.A O no hydrogen 2.877 N/A ARG 303.A NH1 GLU 189.A OE2 no hydrogen 2.805 N/A ARG 303.A NH1 ASN 199.A O no hydrogen 2.895 N/A ARG 303.A NH2 GLU 189.A OE1 no hydrogen 2.613 N/A ARG 303.A NH2 GLU 189.A OE2 no hydrogen 3.089 N/A ARG 303.A NH2 VAL 297.A O no hydrogen 3.311 N/A ARG 303.A NH2 ILE 298.A O no hydrogen 3.249 N/A ILE 304.A N LYS 294.A O no hydrogen 2.974 N/A SER 305.A OG ASP 307.A OD2 no hydrogen 3.042 N/A SER 305.A OG GLU 308.A OE1 no hydrogen 3.026 N/A ALA 309.A N SER 305.A O no hydrogen 3.020 N/A LEU 310.A N VAL 306.A O no hydrogen 2.876 N/A GLN 311.A N GLU 308.A O no hydrogen 3.083 N/A GLN 311.A NE2 GLN 311.A O no hydrogen 3.349 N/A HIS 312.A N ALA 309.A O no hydrogen 3.075 N/A TYR 314.A OH HIS 119.A ND1 no hydrogen 3.000 N/A ILE 315.A N HIS 312.A O no hydrogen 2.992 N/A ASN 316.A N HIS 312.A O no hydrogen 2.625 N/A TRP 318.A NE1 SER 123.A OG no hydrogen 2.734 N/A TYR 319.A N ASN 316.A O no hydrogen 2.996 N/A TYR 319.A OH GLU 325.A OE1 no hydrogen 3.241 N/A SER 322.A N ASP 320.A OD1 no hydrogen 2.936 N/A SER 322.A OG ASP 320.A OD1 no hydrogen 2.509 N/A GLU 323.A N SER 322.A OG no hydrogen 2.623 N/A ALA 324.A N ASP 320.A O no hydrogen 2.813 N/A GLU 325.A N PRO 321.A O no hydrogen 2.691 N/A GLN 335.A NE2 GLN 335.A O no hydrogen 2.849 N/A HIS 341.A ND1 GLU 345.A OE1 no hydrogen 2.940 N/A THR 342.A N GLU 345.A OE1 no hydrogen 3.234 N/A GLU 345.A N THR 342.A OG1 no hydrogen 2.552 N/A TRP 346.A N THR 342.A O no hydrogen 3.090 N/A LYS 347.A N ILE 343.A O no hydrogen 3.209 N/A LYS 347.A NZ LEU 92.A O no hydrogen 2.749 N/A LYS 347.A NZ GLU 93.A O no hydrogen 3.455 N/A LYS 347.A NZ PHE 95.A O no hydrogen 2.840 N/A GLU 348.A N GLU 344.A O no hydrogen 2.717 N/A LEU 349.A N GLU 345.A O no hydrogen 3.429 N/A ILE 350.A N TRP 346.A O no hydrogen 3.143 N/A TYR 351.A N LYS 347.A O no hydrogen 3.205 N/A TYR 351.A OH LYS 90.A O no hydrogen 2.974 N/A LYS 352.A N GLU 348.A O no hydrogen 3.201 N/A GLU 353.A N ILE 350.A O no hydrogen 2.954 N/A VAL 354.A N ILE 350.A O no hydrogen 2.539 N/A MET 355.A N TYR 351.A O no hydrogen 2.760 N/A GLU 358.A N MET 355.A O no hydrogen 2.550 N/A